Information card for entry 2200353

Structure parameters

• Common name: Triisopropylphosphine sulfide
• Chemical name: Triisopropylphosphine sulfide
• Formula: C9 H21 P S
• Calculated formula: C9 H21 P S
• SMILES: C(C)(C)P(C(C)C)(=S)C(C)C
• Title of publication: Triisopropylphosphine sulfide
• Authors of publication: Staples, Richard J.; Segal, Brent M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 5
• Pages of publication: o432 - o433
• a: 13.573 ± 0.001 Å
• b: 13.8717 ± 0.0009 Å
• c: 12.688 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2388.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 72
• Hermann-Mauguin space group symbol: I b a m
• Hall space group symbol: -I 2 2c
• Residual factor for all reflections: 0.1434
• Residual factor for significantly intense reflections: 0.0694
• Weighted residual factors for all reflections included in the refinement: 0.2179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.143
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes